methyl 3-[[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoate CAS Name: 3-[[[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoate Traditional Name: 3-[[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoic acid methyl ester Formula: C17H13N5O5 MolecularWeight: 367.31562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O5/c1-27-17(24)12-3-2-4-13(7-12)20-16(23)11-5-6-14(15(8-11)22(25)26)21-10-18-9-19-21/h2-10H,1H3,(H,20,23)